Vitas-M small molecule compound

3-[(E)-(2-{(2Z)-3-[4-(dimethylamino)phenyl]-2-[(phenylcarbonyl)amino]prop-2-enoyl}hydrazinylidene)methyl]phenyl 3,4,5-trimethoxybenzoate

Catalog ID
STK370397
SMILES COc1cc(cc(c1OC)OC)C(=O)Oc1cccc(c1)/C=N/NC(=O)/C(=C/c1ccc(cc1)N(C)C)/NC(=O)c1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C35H34N4O7 MW 622.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H34N4O7/c1-39(2)27-16-14-23(15-17-27)19-29(37-33(40)25-11-7-6-8-12-25)34(41)38-36-22-24-10-9-13-28(18-24)46-35(42)26-20-30(43-3)32(45-5)31(21-26)44-4/h6-22H,1-5H3,(H,37,40)(H,38,41)/b29-19-,36-22+
InChIKey
CWNZLUYJKRUTQF-JEUWCCCQSA-N
Synonyms

(3((E)(((Z)2benzamido3(4(dimethylamino)phenyl)prop2enoyl)hydrazinylidene)methyl)phenyl)345trimethoxybenzoate
3((E)(2((2Z)3(4(dimethylamino)phenyl)2((phenylcarbonyl)amino)prop2enoyl)hydrazinylidene)methyl)phenyl345trimethoxybenzoate
CN(C)C1=CC=C(C=C1)C=C(C(=O)NN=CC2=CC(=CC=C2)OC(=O)C3=CC(=C(C(=C3)OC)OC)OC)NC(=O)C4=CC=CC=C4
COc1cc(cc(c1OC)OC)C(=O)Oc1cccc(c1)C=NNC(=O)C(=Cc1ccc(cc1)N(C)C)NC(=O)c1ccccc1
InChI=1SC35H34N4O7c139(2)27161423(151727)1929(3733(40)25117681225)34(41)383622241091328(1824)4635(42)262030(433)32(455)31(2126)444h622H15H3(H3740)(H3841)b29193622+
MFCD02066909
ZINC000004018612
ZINC100317638

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Available files

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